Project name: Asparaginase-5OT0

Status: done

Started: 2024-07-04 19:22:46
Settings
Chain sequence(s) A: MKLLVLGTGGTIASAKTEMGYKAALSADDILQLAGIRREDGAKIETRDILNLDSTLIQPEDWVTIGRAVFEAFDEYDGIVITHGTDTLAYTSSALSFMIRNPPIPVVLTGSMLPITEPNSDAPRNLRTALTFARKGFPGIYVAFMDKIMLGTRVSKVHHSLGLNAFQSINYPDIAYVKGDEVLVRHKPRIGNGEPLFDPELDPNVVHIRLTPGLSPEVLRAVARATDGIVLEGYGAGGIPYRGRNLLEVVSETAREKPVVMTTQALYGGVDLTRYEVGRRALEAGVIPAGDMTKEATLTKLMWALGHTRDLEEIRKIMERNIAGEITGS
C: MKLLVLGTGGTIASAKTEMGYKAALSADDILQLAGIRREDGAKIETRDILNLDSTLIQPEDWVTIGRAVFEAFDEYDGIVITHGTDTLAYTSSALSFMIRNPPIPVVLTGSMLPITEPNSDAPRNLRTALTFARKGFPGIYVAFMDKIMLGTRVSKVHHSLGLNAFQSINYPDIAYVKGDEVLVRHKPRIGNGEPLFDPELDPNVVHIRLTPGLSPEVLRAVARATDGIVLEGYGAGGIPYRGRNLLEVVSETAREKPVVMTTQALYGGVDLTRYEVGRRALEAGVIPAGDMTKEATLTKLMWALGHTRDLEEIRKIMERNIAGEITGS
B: MKLLVLGTGGTIASSAKTEMGYKAALSADDILQLAGIRREDGAKIETRDILNLDSTLIQPEDWVTIGRAVFEAFDEYDGIVITHGTDTLAYTSSALSFMIRNPPIPVVLTGSMLPITEPNSDAPRNLRTALTFARKGFPGIYVAFMDKIMLGTTRVSKVHHSLGLNAFQSINYPDIAYVKGDEVLVRHKPRIGNGEPLFDPELDPNVVHIRLTPGLSPEVLRAVARATDGIVLEGYGAGGIPYRGRNLLEVVSETAREKPVVMTTQALYGGVDLTRYEVGRRALEAGVIPAGDMTKEATLTKLMWALGHTRDLEEIRKIMERNIAGEITGS
E: MKLLVLGTGGTIASAKTEMGYKAALSADDILQLAGIRREDGAKIETRDILNLDSTLIQPEDWVTIGRAVFEAFDEYDGIVITHGTDTLAYTSSALSFMIRNPPIPVVLTGSMLPITEPNSDAPRNLRTALTFARKGFPGIYVAFMDKIMLGTRVSKVHSLGLNAFQSINYPDIAYVKGDEVLVRHKPRIGNGEPLFDPELDPNVVHIRLTPGLSPEVLRAVARATDGIVLEGYGAGGIPYRGRNLLEVVSETAREKPVVMTTQALYGGVDLTRYEVGRRALEAGVIPAGDMTKEATLTKLMWALGHTRDLEEIRKIMERNIAGEITGS
D: MKLLVLGTGGTIASSAKTEMGYKAALSADDILQLAGIRREDGAKIETRDILNLDSTLIQPEDWVTIGRAVFEAFDEYDGIVITHGTDTLAYTSSALSFMIRNPPIPVVLTGSMLPITEPNSDAPRNLRTALTFARKGFPGIYVAFMDKIMLGTRVSKVHSLGLNAFQSINYPDIAYVKGDEVLVRHKPRIGNGEPLFDPELDPNVVHIRLTPGLSPEVLRAVARATDGIVLEGYGAGGIPYRGRNLLEVVSETAREKPVVMTTQALYGGVDLTRYEVGRRALEAGVIPAGDMTKEATLTKLMWALGHTRDLEEIRKIMERNIAGEITGS
F: MKLLVLGTGGTIASAKTEMGYKAALSADDILQLAGIRREDGAKIETRDILNLDSTLIQPEDWVTIGRAVFEAFDEYDGIVITHGTDTLAYTSSALSFMIRNPPIPVVLTGSMLPITEPNSDAPRNLRTALTFARKGFPGIYVAFMDKIMLGTRVSKVHHSLGLNAFQSINYPDIAYVKGDEVLVRHKPRIGNGEPLFDPELDPNVVHIRLTPGLSPEVLRAVARATDGIVLEGYGAGGIPYRGRNLLEVVSETAREKPVVMTTQALYGGVDLTRYEVGRRALEAGVIPAGDMTKEATLTKLMWALGHTRDLEEIRKIMERNIAGEITGS
input PDB
Selected Chain(s) A,C,B,E,D,F
Distance of aggregation 10 Å
FoldX usage Yes
Dynamic mode No
Automated mutations No
Downloads Download all the data
Simulation log
[INFO]       Logger:   Verbosity set to: 2 - [INFO]                                                (00:00:00)
[WARNING]    runJob:   Working directory already exists (possibly overwriting previous results -ow 
                       to prevent this behavior)                                                   (00:00:00)
[INFO]       runJob:   Starting aggrescan3d job on: input.pdb with all chain(s) selected           (00:00:00)
[INFO]       runJob:   Creating pdb object from: input.pdb                                         (00:00:00)
[INFO]       FoldX:    Starting FoldX energy minimalization                                        (00:00:02)
[INFO]       Analysis: Starting Aggrescan3D on folded.pdb                                          (00:25:55)
[INFO]       Main:     Simulation completed successfully.                                          (00:26:40)
Show buried residues

Minimal score value
-4.44
Maximal score value
1.3131
Average score
-0.7801
Total score value
-1535.3075

The table below lists A3D score for protein residues. Residues with A3D score > 0.0000 are marked by yellow rows.

residue index residue name chain Aggrescan3D score mutation
residue index residue name chain Aggrescan3D score
mutation
1 M A -0.2912
2 K A -1.4091
3 L A 0.0000
4 L A 0.0000
5 V A 0.0000
6 L A 0.0000
7 G A 0.0000
8 T A 0.0000
9 G A 0.0000
10 G A 0.0000
11 T A 0.1035
12 I A 0.0000
13 A A 0.0000
14 S A 0.0000
15 A A 0.0000
16 K A -2.2348
17 T A 0.0000
18 E A -1.7793
19 M A -0.6734
20 G A -0.6068
21 Y A -0.2858
22 K A -0.5267
23 A A -0.4063
24 A A -0.4502
25 L A 0.0000
26 S A -0.8331
27 A A 0.0000
28 D A -0.9116
29 D A 0.0000
30 I A 0.0000
31 L A 0.0000
32 Q A -0.5897
33 L A -0.2593
34 A A 0.0000
35 G A -0.6900
36 I A -1.2825
37 R A -2.8629
38 R A -3.6696
39 E A -4.1097
40 D A -3.7150
41 G A -2.4011
42 A A 0.0000
43 K A -2.6498
44 I A -1.2506
45 E A -1.3493
46 T A -1.3798
47 R A -2.4499
48 D A -2.1782
49 I A -0.7653
50 L A -0.6445
51 N A -1.0214
52 L A -0.3838
53 D A -0.4153
54 S A 0.0000
55 T A 0.0000
56 L A 0.0000
57 I A 0.0000
58 Q A 0.0000
59 P A 0.0000
60 E A -1.6155
61 D A 0.0000
62 W A 0.0000
63 V A -0.8385
64 T A -0.6809
65 I A 0.0000
66 G A 0.0000
67 R A -1.9399
68 A A 0.0000
69 V A 0.0000
70 F A -1.2008
71 E A -2.7000
72 A A 0.0000
73 F A -1.8150
74 D A -3.0791
75 E A -3.1222
76 Y A -2.0373
77 D A -1.7267
78 G A 0.0000
79 I A 0.0000
80 V A 0.0000
81 I A 0.0000
82 T A 0.0000
83 H A 0.0000
84 G A 0.0000
85 T A 0.0000
86 D A -0.3588
87 T A 0.0000
88 L A 0.0000
89 A A 0.0000
90 Y A 0.0000
91 T A 0.0000
92 S A 0.0000
93 S A 0.0000
94 A A 0.0000
95 L A 0.0000
96 S A 0.0000
97 F A 0.0000
98 M A 0.0000
99 I A 0.0000
100 R A -1.1380
101 N A -1.4461
102 P A -0.6686
103 P A -1.0000
104 I A -0.2447
105 P A 0.0000
106 V A 0.0000
107 V A 0.0000
108 L A 0.0000
109 T A 0.0000
110 G A 0.0000
111 S A 0.0000
112 M A 0.0000
113 L A 0.0230
114 P A -0.5401
115 I A 0.0000
116 T A -1.3771
117 E A -1.5691
118 P A -1.4108
119 N A -1.6897
120 S A -1.0400
121 D A 0.0000
122 A A 0.0000
123 P A -0.7271
124 R A -1.1132
125 N A 0.0000
126 L A 0.0000
127 R A -1.4770
128 T A 0.0000
129 A A 0.0000
130 L A 0.0000
131 T A 0.0000
132 F A 0.0000
133 A A 0.0000
134 R A -1.4039
135 K A -2.1252
136 G A -0.8849
137 F A -0.3574
138 P A -0.4530
139 G A -0.2981
140 I A 0.0000
141 Y A 0.0000
142 V A 0.0000
143 A A 0.0000
144 F A 0.0000
145 M A -0.4806
146 D A -0.6796
147 K A -0.3912
148 I A 0.0000
149 M A 0.0000
150 L A 0.0000
151 G A 0.0000
152 T A 0.0000
153 R A 0.0000
154 V A 0.0000
155 S A 0.0000
156 K A -0.5053
157 V A 0.0000
158 H A -0.0420
159 S A 0.0000
160 L A 0.8305
161 G A 0.3229
162 L A 0.2775
163 N A -0.9815
164 A A 0.0000
165 F A 0.0000
166 Q A -0.7310
167 S A -0.2834
168 I A 0.0000
169 N A -0.3655
170 Y A -0.1623
171 P A -0.5054
172 D A 0.0000
173 I A 0.0000
174 A A 0.0000
175 Y A 0.0000
176 V A 0.0000
177 K A -1.4895
178 G A -1.9339
179 D A -2.8085
180 E A -2.1818
181 V A -0.8988
182 L A 0.1679
183 V A 0.4234
184 R A -0.6368
185 H A -1.3475
186 K A -2.0439
187 P A -1.7396
188 R A -2.1454
189 I A -0.9334
190 G A -1.7650
191 N A -2.1733
192 G A -2.0891
193 E A -2.5033
194 P A -1.2297
195 L A -0.1757
196 F A -0.2984
197 D A -0.7328
198 P A -1.1985
199 E A -2.0192
200 L A -1.1222
201 D A 0.0000
202 P A -0.7820
203 N A -0.7469
204 V A 0.0000
205 V A 0.0000
206 H A 0.0000
207 I A 0.0000
208 R A 0.0000
209 L A 0.0000
210 T A 0.0000
211 P A 0.0000
212 G A 0.0000
213 L A 0.0000
214 S A -1.1443
215 P A -1.5887
216 E A -2.0944
217 V A 0.0000
218 L A 0.0000
219 R A -1.8410
220 A A -1.9686
221 V A 0.0000
222 A A 0.0000
223 R A -2.2845
224 A A -1.7466
225 T A 0.0000
226 D A -1.5033
227 G A 0.0000
228 I A 0.0000
229 V A 0.0000
230 L A 0.0000
231 E A 0.0000
232 G A 0.0000
233 Y A 0.0000
234 G A 0.0000
235 A A 0.0000
236 G A 0.0000
237 G A 0.0000
238 I A 0.0000
239 P A 0.0000
240 Y A -0.9678
241 R A -0.9475
242 G A -1.1899
243 R A -1.2920
244 N A -1.3725
245 L A 0.0000
246 L A -1.4695
247 E A -1.9887
248 V A 0.0000
249 V A 0.0000
250 S A -2.0366
251 E A -2.1905
252 T A 0.0000
253 A A -1.8819
254 R A -3.0293
255 E A -3.4216
256 K A -2.5168
257 P A 0.0000
258 V A 0.0000
259 V A 0.0000
260 M A 0.0000
261 T A 0.0000
262 T A 0.0000
263 Q A -0.2127
264 A A 0.0000
265 L A 0.1181
266 Y A 0.2731
267 G A 0.1059
268 G A 0.0000
269 V A 0.0000
270 D A -1.2998
271 L A 0.0000
272 T A -1.6662
273 R A -1.7399
274 Y A -1.9567
275 E A -2.9575
276 V A 0.0000
277 G A 0.0000
278 R A -3.7011
279 R A -3.2796
280 A A 0.0000
281 L A -1.6934
282 E A -2.6189
283 A A -2.1404
284 G A -1.6280
285 V A 0.0000
286 I A 0.0000
287 P A -0.5480
288 A A 0.0000
289 G A -0.7567
290 D A -0.5699
291 M A 0.0000
292 T A 0.0000
293 K A -0.2333
294 E A 0.0000
295 A A 0.0000
296 T A 0.0000
297 L A 0.0000
298 T A 0.0000
299 K A 0.0000
300 L A 0.0000
301 M A 0.0000
302 W A 0.0000
303 A A 0.0000
304 L A 0.0000
305 G A -1.3471
306 H A -1.7244
307 T A -2.0594
308 R A -3.4607
309 D A -3.7445
310 L A -3.2523
311 E A -3.3119
312 E A -3.6366
313 I A 0.0000
314 R A -3.3108
315 K A -3.8248
316 I A 0.0000
317 M A 0.0000
318 E A -3.3053
319 R A -3.5904
320 N A -2.4976
321 I A -0.9687
322 A A -0.7852
323 G A -0.7980
324 E A 0.0000
325 I A 0.0000
326 T A -1.1140
327 G A -1.5086
328 S A -1.0654
1 M B -0.5933
2 K B -1.7814
3 L B 0.0000
4 L B 0.0000
5 V B 0.0000
6 L B 0.0000
7 G B 0.0000
8 T B 0.0000
9 G B 0.0000
10 G B -0.3738
11 T B -0.0346
12 I B 0.0000
13 A B 0.0000
14 S B -1.0465
15 A B -1.4932
16 K B -2.2248
17 T B -1.3838
18 E B -1.6915
19 M B -0.0504
20 G B -0.5263
21 Y B -0.1663
22 K B -1.8025
23 A B -1.0582
24 A B -0.8148
25 L B -1.0743
26 S B -1.6928
27 A B 0.0000
28 D B -2.5803
29 D B -1.8972
30 I B 0.0000
31 L B 0.0000
32 Q B -1.9330
33 L B 0.0820
34 A B 0.0000
35 G B -1.1378
36 I B -1.6352
37 R B -3.7032
38 R B -3.8150
39 E B -4.2283
40 D B -3.8978
41 G B -2.0772
42 A B -2.3250
43 K B -2.8882
44 I B 0.0000
45 E B -2.1998
46 T B -2.2424
47 R B -3.0045
48 D B -2.7770
49 I B -1.0882
50 L B -0.9135
51 N B -1.3616
52 L B -0.5661
53 D B -0.7667
54 S B 0.0000
55 T B 0.0000
56 L B -0.2577
57 I B 0.0000
58 Q B 0.0000
59 P B 0.0000
60 E B -1.8082
61 D B 0.0000
62 W B 0.0000
63 V B -1.0213
64 T B -0.7972
65 I B 0.0000
66 G B 0.0000
67 R B -2.0838
68 A B -1.4478
69 V B 0.0000
70 F B -1.2493
71 E B -2.7323
72 A B 0.0000
73 F B -1.8773
74 D B -3.0886
75 E B -3.1246
76 Y B -2.1777
77 D B -1.8839
78 G B 0.0000
79 I B 0.0000
80 V B 0.0000
81 I B 0.0000
82 T B 0.0000
83 H B 0.0000
84 G B 0.0000
85 T B 0.0000
86 D B -0.3850
87 T B 0.0000
88 L B 0.0000
89 A B 0.0000
90 Y B 0.0000
91 T B 0.0000
92 S B 0.0000
93 S B 0.0000
94 A B 0.0000
95 L B 0.0000
96 S B 0.0000
97 F B 0.0000
98 M B 0.0000
99 I B 0.0000
100 R B -1.1595
101 N B -1.4845
102 P B -0.7363
103 P B -1.1150
104 I B 0.0000
105 P B 0.0000
106 V B 0.0000
107 V B 0.0000
108 L B 0.0000
109 T B 0.0000
110 G B 0.0000
111 S B 0.0000
112 M B 0.0000
113 L B -0.1452
114 P B -0.5972
115 I B 0.0000
116 T B -1.0352
117 E B -1.9121
118 P B -1.5594
119 N B -1.7933
120 S B -1.1843
121 D B 0.0000
122 A B 0.0000
123 P B -0.7068
124 R B -1.0477
125 N B 0.0000
126 L B 0.0000
127 R B -1.5497
128 T B 0.0000
129 A B 0.0000
130 L B 0.0000
131 T B 0.0000
132 F B 0.0000
133 A B 0.0000
134 R B -1.9158
135 K B -2.4011
136 G B -0.9882
137 F B -0.4713
138 P B -0.5920
139 G B -0.3604
140 I B 0.0000
141 Y B 0.0000
142 V B 0.0000
143 A B 0.0000
144 F B 0.0000
145 M B -0.5228
146 D B -1.2222
147 K B -0.6134
148 I B 0.0000
149 M B 0.0000
150 L B 0.0000
151 G B 0.0000
152 T B 0.0000
153 R B 0.0000
154 V B 0.0000
155 S B 0.0000
156 K B -0.5343
157 V B 0.0000
158 H B -0.0430
159 S B 0.0000
160 L B 1.0130
161 G B 0.3159
162 L B 0.2118
163 N B -1.0255
164 A B 0.0000
165 F B 0.0000
166 Q B -0.8394
167 S B -0.3787
168 I B 0.0000
169 N B -0.3812
170 Y B -0.2358
171 P B -0.9018
172 D B -0.8239
173 I B 0.0000
174 A B 0.0000
175 Y B -0.5278
176 V B 0.0000
177 K B -3.1995
178 G B -2.8817
179 D B -3.6929
180 E B -3.2324
181 V B -1.5665
182 L B -0.0977
183 V B 0.4401
184 R B -1.2961
185 H B -1.7709
186 K B -2.1962
187 P B -1.8638
188 R B -2.1438
189 I B -0.9310
190 G B -1.7857
191 N B -2.1721
192 G B -2.0862
193 E B -2.4599
194 P B -1.2522
195 L B -0.1219
196 F B -0.4460
197 D B -0.7378
198 P B -1.2760
199 E B -2.1091
200 L B -1.3167
201 D B -1.1797
202 P B -1.0216
203 N B -1.0264
204 V B 0.0000
205 V B 0.0000
206 H B 0.0000
207 I B 0.0000
208 R B 0.0000
209 L B 0.0000
210 T B 0.0000
211 P B 0.0000
212 G B 0.0000
213 L B 0.0000
214 S B 0.0000
215 P B -1.7259
216 E B -2.5548
217 V B 0.0000
218 L B 0.0000
219 R B -2.7758
220 A B -2.2627
221 V B 0.0000
222 A B 0.0000
223 R B -2.2968
224 A B -1.7848
225 T B 0.0000
226 D B -1.5181
227 G B 0.0000
228 I B 0.0000
229 V B 0.0000
230 L B 0.0000
231 E B 0.0000
232 G B 0.0000
233 Y B 0.0000
234 G B 0.0000
235 A B 0.0000
236 G B 0.0000
237 G B 0.0000
238 I B 0.0000
239 P B 0.0000
240 Y B -0.7023
241 R B -1.2493
242 G B -1.2879
243 R B -1.1617
244 N B -1.1491
245 L B 0.0000
246 L B -1.3646
247 E B -2.2714
248 V B 0.0000
249 V B 0.0000
250 S B -2.4471
251 E B -3.3966
252 T B 0.0000
253 A B -2.1784
254 R B -3.3468
255 E B -3.5843
256 K B -2.5278
257 P B 0.0000
258 V B 0.0000
259 V B 0.0000
260 M B 0.0000
261 T B 0.0000
262 T B 0.0000
263 Q B -0.1883
264 A B 0.0000
265 L B 0.1632
266 Y B 0.3095
267 G B 0.0704
268 G B 0.0000
269 V B 0.0000
270 D B -1.4215
271 L B 0.0000
272 T B -0.9999
273 R B -0.9437
274 Y B -0.6970
275 E B -0.7734
276 V B 0.0000
277 G B 0.0000
278 R B -1.9270
279 R B -1.4322
280 A B 0.0000
281 L B -0.8815
282 E B -1.9833
283 A B -1.8901
284 G B -1.7028
285 V B 0.0000
286 I B 0.0000
287 P B -0.5539
288 A B 0.0000
289 G B -0.8147
290 D B -0.5976
291 M B 0.0000
292 T B 0.0000
293 K B -0.2275
294 E B 0.0000
295 A B 0.0000
296 T B 0.0000
297 L B 0.0000
298 T B 0.0000
299 K B 0.0000
300 L B 0.0000
301 M B 0.0000
302 W B 0.0000
303 A B 0.0000
304 L B 0.0000
305 G B -1.4193
306 H B -1.6657
307 T B -1.9478
308 R B -3.1130
309 D B -3.6629
310 L B -3.2489
311 E B -3.5398
312 E B -3.5495
313 I B 0.0000
314 R B -3.0330
315 K B -3.3585
316 I B -2.1940
317 M B 0.0000
318 E B -2.8221
319 R B -3.0346
320 N B -1.7888
321 I B -0.6069
322 A B -0.6180
323 G B -0.6097
324 E B 0.0000
325 I B 0.0000
326 T B -0.9822
327 G B -1.3362
328 S B -0.4545
1 M C -0.7868
2 K C -1.4425
3 L C 0.0000
4 L C 0.0000
5 V C 0.0000
6 L C 0.0000
7 G C 0.0000
8 T C 0.0000
9 G C 0.0000
10 G C 0.0000
11 T C 0.0675
12 I C 0.0000
13 A C 0.0000
14 S C 0.0000
15 A C -0.9803
16 K C -2.0238
17 T C -1.4753
18 E C -1.7522
19 M C -0.2481
20 G C -0.8367
21 Y C -1.0012
22 K C -1.3868
23 A C -0.7913
24 A C -0.6091
25 L C -0.7197
26 S C -1.4907
27 A C 0.0000
28 D C -2.0840
29 D C -1.3529
30 I C 0.0000
31 L C 0.0000
32 Q C -0.9917
33 L C -0.1837
34 A C 0.0000
35 G C -0.6689
36 I C -1.0626
37 R C -2.5089
38 R C -3.0341
39 E C -3.7646
40 D C -3.6365
41 G C -2.1041
42 A C -2.1381
43 K C -2.5190
44 I C -1.2792
45 E C -1.3498
46 T C -1.8209
47 R C -2.8616
48 D C -2.7515
49 I C -1.0119
50 L C -0.7440
51 N C -1.1859
52 L C -0.4829
53 D C -0.5765
54 S C 0.0000
55 T C 0.0000
56 L C 0.0000
57 I C 0.0000
58 Q C 0.0000
59 P C 0.0000
60 E C -1.7832
61 D C 0.0000
62 W C 0.0000
63 V C -0.9791
64 T C -0.7753
65 I C 0.0000
66 G C 0.0000
67 R C -2.0653
68 A C -1.6382
69 V C 0.0000
70 F C -1.2115
71 E C -2.7243
72 A C 0.0000
73 F C -1.8093
74 D C -3.0790
75 E C -3.1231
76 Y C -2.0517
77 D C -1.8408
78 G C 0.0000
79 I C 0.0000
80 V C 0.0000
81 I C 0.0000
82 T C 0.0000
83 H C 0.0000
84 G C 0.0000
85 T C 0.0000
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13 A F 0.0000
14 S F 0.0000
15 A F -1.2236
16 K F -2.1904
17 T F -1.5666
18 E F -1.6696
19 M F -0.5719
20 G F -1.0818
21 Y F -1.1672
22 K F -1.8912
23 A F 0.0000
24 A F -0.6994
25 L F -0.8272
26 S F -1.4925
27 A F 0.0000
28 D F -2.7124
29 D F -1.3193
30 I F 0.0000
31 L F 0.0000
32 Q F -1.5063
33 L F 0.5203
34 A F -0.5275
35 G F -0.8186
36 I F -1.4467
37 R F -4.0289
38 R F -3.8504
39 E F -4.2889
40 D F -3.7737
41 G F -2.0813
42 A F 0.0000
43 K F -2.6447
44 I F -1.5767
45 E F -1.6616
46 T F -1.5303
47 R F -1.8126
48 D F -2.3097
49 I F -0.8032
50 L F -0.7808
51 N F -1.5878
52 L F -0.8319
53 D F -0.9507
54 S F 0.0000
55 T F 0.0000
56 L F 0.0000
57 I F 0.0000
58 Q F 0.0000
59 P F 0.0000
60 E F -1.9388
61 D F 0.0000
62 W F 0.0000
63 V F -0.9347
64 T F -0.7653
65 I F 0.0000
66 G F 0.0000
67 R F -2.0417
68 A F -1.2780
69 V F 0.0000
70 F F -1.2128
71 E F -2.7300
72 A F 0.0000
73 F F -1.8877
74 D F -3.1488
75 E F -3.2662
76 Y F 0.0000
77 D F -2.0348
78 G F 0.0000
79 I F 0.0000
80 V F 0.0000
81 I F 0.0000
82 T F 0.0000
83 H F 0.0000
84 G F 0.0000
85 T F 0.0000
86 D F -0.3666
87 T F 0.0000
88 L F 0.0000
89 A F 0.0000
90 Y F 0.0000
91 T F 0.0000
92 S F 0.0000
93 S F 0.0000
94 A F 0.0000
95 L F 0.0000
96 S F 0.0000
97 F F 0.0000
98 M F 0.0000
99 I F 0.0000
100 R F -0.9897
101 N F -1.5188
102 P F 0.0000
103 P F -0.9938
104 I F -0.2354
105 P F 0.0000
106 V F 0.0000
107 V F 0.0000
108 L F 0.0000
109 T F 0.0000
110 G F 0.0000
111 S F 0.0000
112 M F 0.0000
113 L F 0.1901
114 P F 0.0000
115 I F 0.0000
116 T F -0.7036
117 E F -1.4237
118 P F -1.1607
119 N F -1.5440
120 S F -1.0631
121 D F 0.0000
122 A F 0.0000
123 P F -1.3195
124 R F -2.6935
125 N F 0.0000
126 L F 0.0000
127 R F -2.7666
128 T F -2.4034
129 A F 0.0000
130 L F 0.0000
131 T F 0.0000
132 F F 0.0000
133 A F 0.0000
134 R F -1.2726
135 K F -2.3543
136 G F -0.9546
137 F F -0.3755
138 P F -0.3834
139 G F 0.0000
140 I F 0.0000
141 Y F 0.0000
142 V F 0.0000
143 A F 0.0000
144 F F 0.0000
145 M F 0.0000
146 D F -2.2539
147 K F -0.9529
148 I F 0.0000
149 M F 0.0000
150 L F 0.0000
151 G F 0.0000
152 T F 0.0000
153 R F 0.0000
154 V F 0.0000
155 S F 0.0000
156 K F -0.4323
157 V F 0.0000
158 H F 0.1403
159 S F 0.0000
160 L F 1.3131
161 G F 0.4603
162 L F 0.2553
163 N F -0.8908
164 A F 0.0000
165 F F 0.0000
166 Q F -0.5769
167 S F -0.2904
168 I F 0.0000
169 N F -0.4111
170 Y F -0.2347
171 P F -0.8876
172 D F -0.9119
173 I F 0.0000
174 A F 0.0000
175 Y F -0.7953
176 V F 0.0000
177 K F -3.1787
178 G F -3.1498
179 D F -3.6341
180 E F -3.0624
181 V F -1.5350
182 L F -0.1181
183 V F -0.1077
184 R F -1.7498
185 H F -2.0046
186 K F -2.4075
187 P F -1.9100
188 R F -2.2239
189 I F -1.0635
190 G F -1.6042
191 N F -2.1340
192 G F -1.9940
193 E F -2.4051
194 P F -1.1884
195 L F -0.2090
196 F F -0.5465
197 D F -0.8489
198 P F -1.3209
199 E F -2.1279
200 L F -1.2787
201 D F -1.0501
202 P F -0.8641
203 N F -0.8458
204 V F 0.0000
205 V F 0.0000
206 H F 0.0000
207 I F 0.0000
208 R F 0.0000
209 L F 0.0000
210 T F 0.0000
211 P F 0.0000
212 G F 0.0000
213 L F 0.0000
214 S F -1.2765
215 P F -1.8971
216 E F -2.5742
217 V F 0.0000
218 L F 0.0000
219 R F -3.1666
220 A F -2.4054
221 V F 0.0000
222 A F 0.0000
223 R F -2.3737
224 A F -1.8820
225 T F 0.0000
226 D F -1.2941
227 G F 0.0000
228 I F 0.0000
229 V F 0.0000
230 L F 0.0000
231 E F 0.0000
232 G F 0.0000
233 Y F 0.0000
234 G F 0.0000
235 A F 0.0000
236 G F 0.0000
237 G F 0.0000
238 I F 0.0000
239 P F 0.0000
240 Y F -0.9530
241 R F -1.3135
242 G F -1.3657
243 R F -1.2629
244 N F -1.3745
245 L F 0.0000
246 L F -1.4451
247 E F -2.3387
248 V F 0.0000
249 V F 0.0000
250 S F -2.4717
251 E F -3.4572
252 T F 0.0000
253 A F -2.1991
254 R F -3.3581
255 E F -3.4816
256 K F -2.4583
257 P F 0.0000
258 V F 0.0000
259 V F 0.0000
260 M F 0.0000
261 T F 0.0000
262 T F 0.0000
263 Q F -0.1970
264 A F 0.0000
265 L F 0.1733
266 Y F 0.2486
267 G F -0.0082
268 G F 0.0000
269 V F 0.0000
270 D F -1.6733
271 L F 0.0000
272 T F -1.5293
273 R F -1.9650
274 Y F -1.2607
275 E F -1.1977
276 V F 0.0000
277 G F 0.0000
278 R F -2.3522
279 R F -1.6285
280 A F 0.0000
281 L F -1.1197
282 E F -2.6521
283 A F -1.9728
284 G F -1.5171
285 V F 0.0000
286 I F 0.0000
287 P F -0.5476
288 A F 0.0000
289 G F -0.8125
290 D F -0.6200
291 M F 0.0000
292 T F 0.0000
293 K F -0.2360
294 E F 0.0000
295 A F 0.0000
296 T F 0.0000
297 L F 0.0000
298 T F 0.0000
299 K F 0.0000
300 L F 0.0000
301 M F 0.0000
302 W F 0.0000
303 A F 0.0000
304 L F 0.0000
305 G F -1.4513
306 H F -1.6289
307 T F -1.7302
308 R F -2.9238
309 D F -2.6486
310 L F -2.4387
311 E F -3.1856
312 E F -2.9424
313 I F 0.0000
314 R F -2.2421
315 K F -2.8749
316 I F -1.6459
317 M F 0.0000
318 E F -2.6023
319 R F -3.0843
320 N F -2.1751
321 I F -0.7561
322 A F -0.6508
323 G F -0.7457
324 E F 0.0000
325 I F 0.0000
326 T F -1.1145
327 G F -1.4981
328 S F -0.4560
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Laboratory of Theory of Biopolymers 2018